SCHEMBL3504489

SCHEMBL3504489

CC(C)Cc1ccc(C(Nc2cccc(C(=O)c3cn(CCCC(=O)O)c4ccccc34)c2)c2ccc(CC(C)C)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 6/20 1.00
SRD5A2 P31213 6/20 1.00
CNR1 P21554 3/20 0.49
CNR2 P34972 3/20 0.49
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 1/20 0.41
CREBBP Q92793 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29633452 1.00 SRD5A1 (1.00) SRD5A1SRD5A2CNR1CNR2MAPT
Hydrochloric Acid SCHEMBL8793978 0.99 SRD5A1 (0.98) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL8793523 0.97 SRD5A1 (0.95) SRD5A1SRD5A2CNR1CNR2MAPT
N-Phenylbenzamide SCHEMBL6762152 0.95 SRD5A1 (0.91) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL9386762 0.95 SRD5A1 (0.91) SRD5A1SRD5A2CNR1CNR2
SCHEMBL8792770 0.95 SRD5A1 (0.90) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL8793385 0.93 SRD5A1 (0.88) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL9336300 0.93 SRD5A1 (0.86) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL9337867 0.91 SRD5A1 (0.84) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL8792545 0.91 SRD5A1 (0.83) SRD5A1SRD5A2CNR1CNR2MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0458207-B1 Indole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1997-03-26 EP claimed
US-5212320-A Enzyme inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-18 US claimed
EP-0458207-A2 Indole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-11-27 EP claimed
JP-4244061-A None JP disclosed
EP-3220942-B1 COMPOSITIONS COMPRISING LOW DOSE DESMOPRESSIN IN COMBINATION WITH AN ALPHA-ADRENERGIC RECEPTOR ANTAGONIST SERENITY PHARMACEUTICALS LLC (US) 2022-04-27 EP disclosed
US-10286033-B2 Methods and compositions comprising desmopressin in combination with an alpha-adrenergic receptor antagonist SERENITY PHARMACEUTICALS, LLC (US) 2019-05-14 US disclosed
US-9925232-B2 Methods and compositions comprising desmopressin in combination with a 5-alpha reductase inhibitor SERENITY PHARMACEUTICALS, LLC (US) 2018-03-27 US disclosed
US-20170319646-A1 METHODS AND COMPOSITIONS COMPRISING DESMOPRESSIN IN COMBINATION WITH AN ALPHA-ADRENERGIC RECEPTOR ANTAGONIST FIRST GENERATION CAPITAL INC. (CA) 2017-11-09 US disclosed
EP-3220942-A1 METHODS AND COMPOSITIONS COMPRISING DESMOPRESSIN IN COMBINATION WITH AN ALPHA-ADRENERGIC RECEPTOR ANTAGONIST Serenity Pharmaceuticals LLC (US) 2017-09-27 EP disclosed
EP-3024473-A1 METHODS AND COMPOSITIONS COMPRISING DESMOPRESSIN IN COMBINATION WITH A 5-ALPHA REDUCTASE INHIBITOR ALLERGAN, INC. (US) 2016-06-01 EP disclosed
WO-2016081772-A1 METHODS AND COMPOSITIONS COMPRISING DESMOPRESSIN IN COMBINATION WITH AN ALPHA-ADRENERGIC RECEPTOR ANTAGONIST ALLERGAN, INC. (US) 2016-05-26 WO disclosed
WO-2015013453-A1 METHODS AND COMPOSITIONS COMPRISING DESMOPRESSIN IN COMBINATION WITH A 5-ALPHA REDUCTASE INHIBITOR ALLERGAN, INC. (US) 2015-01-29 WO disclosed
US-8278291-B1 Treatment of wrinkles and strias with 4-hydroxyandrostenedione or a derivative thereof CURADIS GMBH (DE) 2012-10-02 US disclosed
US-20100184213-A1 APOCRINE CELL LINE CONOPCO, INC. D/B/A UNILEVER 2010-07-22 US disclosed
US-20070148123-A1 Substances and agents for positively influencing collagen WIELAND HEINRICH 2007-06-28 US disclosed
EP-0458207-B1 Indole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1997-03-26 EP disclosed
US-5312829-A Testosterone 5alpha-reductase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-17 US disclosed
US-5212320-A Enzyme inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-18 US disclosed
JP-H04244061-A INDOLE DERIVATIVE FUJISAWA PHARMACEUT CO LTD 1992-09-01 JP disclosed
EP-0458207-A2 Indole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-11-27 EP disclosed